Tb4Pr2Sb3N2
Alexandria ALEXAlex-ID: agm004490902 · Space group: I4/mmm (#139)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B2C3D4_39_spg139
Tb5Sb3 Pr4Sb3 PrSb TbN
2022-06-18 03:47:02.979776
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm004490902).
Th. Cavignac, J. Schmidt, P.-P. De Breuck, A. Loew, T. F. T. Cerqueira, H.-C. Wang, A. Bochkarev, Y. Lysogorskiy, A. H. Romero, R. Drautz, S. Botti and M. A. L. Marques. AI-Driven expansion and application of the Alexandria database. J. Phys. Mater. 9, 025014 (2026). https://doi.org/10.1088/2515-7639/ae6620
@article{Cavignac2026Alexandria,
author = {Cavignac, Th{\'e}o and Schmidt, Jonathan and De Breuck, Pierre-Paul and Loew, Antoine
and Cerqueira, Tiago F. T. and Wang, Hai-Chen and Bochkarev, Anton
and Lysogorskiy, Yury and Romero, Aldo H. and Drautz, Ralf and Botti, Silvana
and Marques, Miguel A. L.},
title = {{AI}-Driven expansion and application of the {A}lexandria database},
journal = {Journal of Physics: Materials},
year = {2026},
volume = {9},
number = {2},
pages = {025014},
doi = {10.1088/2515-7639/ae6620},
url = {https://doi.org/10.1088/2515-7639/ae6620}
}
3D Crystal Structure Rendering
Loading 3D structure…
# CIF generated by HEAS from Alexandria entry agm004490902
data_agm004490902
_cell_length_a 4.69504
_cell_length_b 4.69504
_cell_length_c 13.26816
_cell_angle_alpha 100.19093
_cell_angle_beta 100.19093
_cell_angle_gamma 90.00000
_cell_volume 283.17222
_symmetry_space_group_name_H-M 'P 1'
_symmetry_Int_Tables_number 1
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_occupancy
Tb1 Tb 0.41794 0.91794 0.83589 1.00000
Tb2 Tb 0.91794 0.41794 0.83589 1.00000
Tb3 Tb 0.08206 0.58206 0.16411 1.00000
Tb4 Tb 0.58206 0.08206 0.16411 1.00000
Pr1 Pr 0.30654 0.30654 0.61308 1.00000
Pr2 Pr 0.69346 0.69346 0.38692 1.00000
Sb1 Sb 0.00000 0.00000 0.00000 1.00000
Sb2 Sb 0.17565 0.17565 0.35129 1.00000
Sb3 Sb 0.82435 0.82435 0.64871 1.00000
N1 N 0.40194 0.40194 0.80388 1.00000
N2 N 0.59806 0.59806 0.19612 1.00000
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